CID 58091543

5-amino-n,n-dimethyl-1,3,4-thiadiazole-2-carboxamide

Structural Information

Molecular Formula
C5H8N4OS
SMILES
CN(C)C(=O)C1=NN=C(S1)N
InChI
InChI=1S/C5H8N4OS/c1-9(2)4(10)3-7-8-5(6)11-3/h1-2H3,(H2,6,8)
InChIKey
BLQZBVCYJPMNDV-UHFFFAOYSA-N
Compound name
5-amino-N,N-dimethyl-1,3,4-thiadiazole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

172.04189 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.04917 134.0
[M+Na]+ 195.03111 142.8
[M-H]- 171.03461 136.9
[M+NH4]+ 190.07571 154.0
[M+K]+ 211.00505 142.1
[M+H-H2O]+ 155.03915 126.7
[M+HCOO]- 217.04009 153.9
[M+CH3COO]- 231.05574 183.5
[M+Na-2H]- 193.01656 135.8
[M]+ 172.04134 135.5
[M]- 172.04244 135.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe